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Ammodendrine

Base Information Edit
  • Chemical Name:Ammodendrine
  • CAS No.:494-15-5
  • Molecular Formula:C12H20N2O
  • Molecular Weight:208.3
  • Hs Code.:
  • UNII:U0X8I482C7
  • DSSTox Substance ID:DTXSID70964226
  • Nikkaji Number:J92.893C
  • Wikidata:Q27105761
  • Metabolomics Workbench ID:52963
  • ChEMBL ID:CHEMBL464777
  • Mol file:494-15-5.mol
Ammodendrine

Synonyms:ammodendrine

Suppliers and Price of Ammodendrine
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • American Custom Chemicals Corporation
  • AMMODENDRINE 95.00%
  • 5MG
  • $ 498.39
Total 2 raw suppliers
Chemical Property of Ammodendrine Edit
Chemical Property:
  • Vapor Pressure:7.99E-06mmHg at 25°C 
  • Melting Point:73-74 °C 
  • Boiling Point:375.1°Cat760mmHg 
  • PKA:10.29±0.10(Predicted) 
  • Flash Point:180.6°C 
  • PSA:32.34000 
  • Density:1.061g/cm3 
  • LogP:1.92140 
  • XLogP3:0.3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Rotatable Bond Count:1
  • Exact Mass:208.157563266
  • Heavy Atom Count:15
  • Complexity:273
Purity/Quality:

97% *data from raw suppliers

AMMODENDRINE 95.00% *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC(=O)N1CCCC(=C1)C2CCCCN2
  • Isomeric SMILES:CC(=O)N1CCCC(=C1)[C@H]2CCCCN2
Technology Process of Ammodendrine

There total 3 articles about Ammodendrine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
L-Ala-D-ammodendrine; With phenyl isothiocyanate; triethylamine; In methanol; at 50 ℃; for 1.5h;
With trifluoroacetic acid; In methanol; at 50 ℃; for 1.5h;
DOI:10.1021/np0580199
Guidance literature:
With 6,6′-dinitro[1,1′-biphenyl]-2,2′-dicarboxylic acid;
Guidance literature:
Multi-step reaction with 2 steps
1.1: piperidine / CH2Cl2 / 1 h / 20 °C
2.1: aq. Et3N; phenylisothiocyanate / methanol / 1.5 h / 50 °C
2.2: TFA / methanol / 1.5 h / 50 °C
With piperidine; phenyl isothiocyanate; triethylamine; In methanol; dichloromethane; 2.1: Edman degradation;
DOI:10.1021/np0580199
upstream raw materials:

Ammodendrin

L-Ala-D-ammodendrine

Fmoc-L-Ala-ammodendrine

Downstream raw materials:

N-methylammodendrine

Refernces Edit
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